2-[4-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazin-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazin-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyl]piperazin-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]-1-piperazinyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]piperazin-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(4-benzoxy-3-bromo-5-ethoxy-benzyl)piperazino]-N,N-dimethyl-acetamide Formula: C24H32BrN3O3 MolecularWeight: 490.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CN2CCN(CC2)CC(=O)N(C)C)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CN2CCN(CC2)CC(=O)N(C)C)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C24H32BrN3O3/c1-4-30-22-15-20(14-21(25)24(22)31-18-19-8-6-5-7-9-19)16-27-10-12-28(13-11-27)17-23(29)26(2)3/h5-9,14-15H,4,10-13,16-18H2,1-3H3